Trichloromethanesulfonyl chloride

Base Information

• Chemical Name: Trichloromethanesulfonyl chloride
• CAS No.: 2547-61-7
• Molecular Formula: CCl4 O2 S
• Molecular Weight: 217.888
• Hs Code.: 2904909090
• European Community (EC) Number: 219-830-1
• NSC Number: 59663
• DSSTox Substance ID: DTXSID0062507
• Nikkaji Number: J150.148H
• Wikidata: Q72510284
• Mol file: 2547-61-7.mol

Synonyms:Trichloromethanesulfonyl chloride;2547-61-7;Trichloromethylsulfonyl chloride;Methanesulfonyl chloride, trichloro-;Trichloromethanesulphonyl chloride;Trichloromethane sulfonyl chloride;CCl4O2S;Trichloromethanesulfonylchloride;EINECS 219-830-1;MFCD00007452;NSC 59663;ethyl4-isopropylphenylacetate;SCHEMBL80212;C-Cl4-O2-S;DTXSID0062507;NSC59663;BBL027641;NSC-59663;STL373469;AKOS006222950;Trichloromethanesulfonyl chloride, 97%;VS-08573;FT-0634354;T0611;D92368;EN300-298206;J-016008;Z1203132650

Chemical Property of Trichloromethanesulfonyl chloride

Chemical Property:

• Vapor Pressure: 1.14mmHg at 25°C
• Melting Point: 137-140 °C
• Refractive Index: 1.536
• Boiling Point: 181.7 °C at 760 mmHg
• Flash Point: 63.7 °C
• PSA: 42.52000
• Density: 1.951g/cm³
• LogP: 2.96350
• Solubility.: soluble in Toluene
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 217.834361
• Heavy Atom Count: 8
• Complexity: 158

Purity/Quality:

98%,99%, ^*data from raw suppliers

Trichloromethanesulfonyl Chloride ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C
• Statements: 34-36/37
• Safety Statements: 26-27-28-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(S(=O)(=O)Cl)(Cl)(Cl)Cl

Technology Process of Trichloromethanesulfonyl chloride

There total 13 articles about Trichloromethanesulfonyl chloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 70.0%

chlorothio-trichloro-methane (594-42-3) → Trichloromethanesulfonyl chloride (2547-61-7)

Guidance literature:

With dihydrogen peroxide; In acetic acid; Ambient temperature;

Reference yield:

carbon disulfide (75-15-0,12122-00-8) + water (7732-18-5) + chlorine (7782-50-5) → Trichloromethanesulfonyl chloride (2547-61-7) + chlorothio-trichloro-methane (594-42-3)

Guidance literature:

Reference yield:

water (7732-18-5) + chlorine (7782-50-5) + [1,3,5]trithiane (291-21-4) → tetrachloromethane (56-23-5) + Trichloromethanesulfonyl chloride (2547-61-7) + dichloromethane (75-09-2) + bis(chloromethyl)sulfide (3592-44-7)

Guidance literature:

upstream raw materials:

trichloromethanesulfinic acid

chlorothio-trichloro-methane

water

chlorine

Downstream raw materials:

1,1,1,3-tetrachloro-3-phenylpropane

2,4,4,4-tetrachlorobutanol

formamidine disulfide dihydrochloride

1,5,5,5-Tetrachlor-1,3-diphenyl-pentan

Refernces

• 1、 Schechter,Haller. "-". . p. 1764. Retrieved 1941.
• 2、 Bussas, Reinhard,Kresze, Guenter. "Reactions of N-Sulfinyl Compounds, XV. - Synthesis of 2-Alkenesulfinic Acid Amides - Structure-Reactivity Relationships for N-Sulfinyl Compounds as Enophiles". . p. 545 - 563. Retrieved 2007/10/02.
• 3、 -. "N-sulfonyl-N-dihalophenylimidazolidinediones". . . Retrieved 2008/06/13.